#MD System 2.0 @Title neb0_image04 @Columns AsymmetricAtom AtomicNumber int 0 Connections string {{}} Fractional double {{0.0 0.0 0.0}} Name string {{}} Site int 1 WyckoffPosition int -1 @end @data 8 {} {0.467513534421 0.261962907631 0.491276088732} O1 1 1 14 {} {0.32613802546 0.230374382125 0.567645808373} Si1 2 1 14 {} {0.599271858541 0.348350072783 0.447438693905} Si2 3 1 8 {} {0.558779440426 0.504772048336 0.42754449508} O2 4 1 8 {} {0.283090022165 0.348799019301 0.672105570381} O3 5 1 14 {} {0.239973524422 0.5039142163 0.700421236007} Si3 6 1 14 {} {0.581647502643 0.665345219152 0.401130304648} Si4 7 1 1 {} {0.343852743214 0.105812478151 0.648189212832} H1 8 1 1 {} {0.218371196698 0.214432458666 0.465422728251} H2 9 1 1 {} {0.648127234903 0.291729721468 0.319697043458} H3 10 1 1 {} {0.700389371066 0.338116251296 0.555300274146} H4 11 1 1 {} {0.106722385767 0.506788437821 0.766365431035} H5 12 1 1 {} {0.342804398471 0.563754659004 0.789862177444} H6 13 1 1 {} {0.458684761586 0.739180110011 0.438795422587} H7 14 1 1 {} {0.612462008236 0.688649264341 0.256919037547} H8 15 1 1 {} {0.695841251367 0.71508488337 0.48340636758} H10 16 1 8 {} {0.23576588273 0.579919859777 0.552496587469} O 17 1 1 {} {0.190650808788 0.665531811537 0.547041788452} H14 18 1 @end @Columns Cell Constraints string {a b c A B G} Origin int {{0 0 0}} Parameters double {{10.0 10.0 10.0 90.0 90.0 90.0}} PrimitiveData double {{{1.0 0.0 0.0} {0.0 1.0 0.0} {0.0 0.0 1.0}}} RotationMatrix double {{{1.0 0.0 0.0} {0.0 1.0 0.0} {0.0 0.0 1.0}}} SpaceGroup string P1 SpaceGroupNumber int 1 ToCartesians double {{{10.0 0.0 0.0} {0.0 10.0 0.0} {0.0 0.0 10.0}}} ToFractionals double {{{0.10000000000000001 0.0 0.0} {0.0 0.10000000000000001 0.0} {0.0 0.0 0.10000000000000001}}} @end @data {a b c A B G} {0 0 0} {10 10 10 90 90 90} {{1 0 0} {0 1 0} {0 0 1}} {{1 0 0} {0 1 0} {0 0 1}} P1 1 {{10 0 0} {0 10 0} {0 0 10}} {{0.1 0 0} {0 0.1 0} {0 0 0.1}} @end @Columns AsymmetricBond Atom1 reference AsymmetricAtom Atom2 reference AsymmetricAtom Key int 0 Order int 0 @end @data 1 0 0 0 2 0 0 0 14 6 0 0 16 5 0 2 15 6 0 0 4 1 0 0 3 2 0 0 7 1 0 0 8 1 0 0 6 3 0 0 5 4 0 0 10 2 0 0 9 2 0 0 @end @Columns Bond AsymmetricBond reference AsymmetricBond Atom1 reference Atom Atom2 reference Atom CellOffset2 int {{0 0 0}} Key int 0 @end @data 0 0 1 {0 0 0} 0 1 0 2 {0 0 0} 0 2 14 6 {0 0 0} 0 3 16 5 {0 0 0} 0 4 15 6 {0 0 0} 0 5 4 1 {0 0 0} 0 6 3 2 {0 0 0} 0 7 7 1 {0 0 0} 0 8 8 1 {0 0 0} 0 9 6 3 {0 0 0} 0 10 5 4 {0 0 0} 0 11 10 2 {0 0 0} 0 12 9 2 {0 0 0} 0 @end @Columns Subset Color string {{#65d9f0}} Criteria string {{}} DisplayLine int 0 IeqJ int 1 IgtJ int 0 IltJ int 0 Length int 1 Name string {{}} Table string {{}} Type string atom UseColor int 0 @end @data @end